Information card for entry 4304442

Structure parameters

• Common name: [Mo2(DmCF3F)3]2(C4O4), C3.5 H10 O1.5 Cl
• Formula: C97.5 H64 Cl F36 Mo4 N12 O5.5
• Calculated formula: C97.498 H64 Cl F35.994 Mo4 N12 O5.5
• Title of publication: Very Large Difference in Electronic Communication of Dimetal Species with Heterobiphenylene and Heteroanthracene Units
• Authors of publication: F. Albert Cotton; Carlos A. Murillo; Mark D. Young; Rongmin Yu; Qinliang Zhao
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 219 - 229
• a: 11.215 ± 0.005 Å
• b: 14.914 ± 0.006 Å
• c: 17.306 ± 0.007 Å
• α: 97.915 ± 0.007°
• β: 106.328 ± 0.008°
• γ: 104.691 ± 0.006°
• Cell volume: 2618.1 ± 1.9 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0682
• Residual factor for significantly intense reflections: 0.0495
• Weighted residual factors for significantly intense reflections: 0.1228
• Weighted residual factors for all reflections included in the refinement: 0.1405
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No